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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H30O13
Molecular Weight 562.5204
Optical Activity UNSPECIFIED
Defined Stereocenters 9 / 9
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LIGNAN P

SMILES

COc1cc(cc(c1O)OC)[C@]2([H])c3cc4c(cc3[C@]([H])([C@@]5([H])COC(=O)[C@@]52[H])O[C@@]6([H])[C@@]([H])([C@]([H])([C@@]([H])([C@@]([H])(CO)O6)O)O)O)OCO4

InChI

InChIKey=FOVRGQUEGRCWPD-BRLGUANISA-N
InChI=1S/C27H30O13/c1-34-16-3-10(4-17(35-2)21(16)29)19-11-5-14-15(38-9-37-14)6-12(11)25(13-8-36-26(33)20(13)19)40-27-24(32)23(31)22(30)18(7-28)39-27/h3-6,13,18-20,22-25,27-32H,7-9H2,1-2H3/t13-,18+,19+,20-,22+,23-,24+,25+,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H30O13
Molecular Weight 562.5204
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 9 / 9
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 13:21:18 UTC 2021
Edited
by admin
on Sat Jun 26 13:21:18 UTC 2021
Record UNII
C2G3ZRK3U4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LIGNAN P
Common Name English
PPTOXIN II
Common Name English
4'-DEMETHYLEPIPODOPHYLLOTOXIN .BETA.-D-GLUCOPYRANOSIDE
Common Name English
TENIPOSIDE IMPURITY, LIGNAN P [USP]
Common Name English
FURO(3',4':6,7)NAPHTHO(2,3-D)-1,3-DIOXOL-6(5AH)-ONE, 9-(.BETA.-D-GLUCOPYRANOSYLOXY)-5,8,8A,9-TETRAHYDRO-5-(4-HYDROXY-3,5-DIMETHOXYPHENYL)-, (5R,5AR,8AR,9S)-
Systematic Name English
EPIPODOPHYLLOTOXIN, 4'-DEMETHYL-, 9-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
4-DEMETHYLEPIPODOPHYLLOTOXIN 7'-O-.BETA.-D-GLUCOPYRANOSIDE
Common Name English
4'-DEMETHYLEPIPODOPHYLLOTOXIN-BETA-D-GLUCOSIDE
Common Name English
Code System Code Type Description
CAS
23363-35-1
Created by admin on Sat Jun 26 13:21:19 UTC 2021 , Edited by admin on Sat Jun 26 13:21:19 UTC 2021
PRIMARY
PUBCHEM
159949
Created by admin on Sat Jun 26 13:21:19 UTC 2021 , Edited by admin on Sat Jun 26 13:21:19 UTC 2021
PRIMARY
FDA UNII
C2G3ZRK3U4
Created by admin on Sat Jun 26 13:21:19 UTC 2021 , Edited by admin on Sat Jun 26 13:21:19 UTC 2021
PRIMARY
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